L464-0551 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperazine

L464-0551 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperazine
L464-0551 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound L464-0551
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperazine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

L464-0551

Molecular Formula

C21H23N3O5S2 (C21 H23 N3 O5 S2)

Compound Name

1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[5-(3,4-dimethyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperazine

IUPAC name

1-[(2H-13-benzodioxol-5-yl)methyl]-4-{[5-(34-dimethyl-12-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperazine

SMILES

Cc1c(-c(s2)ccc2S(N2CCN(Cc(cc3)cc4c3OCO4)CC2)(=O)=O)onc1C

InChI

InChI=1S/C21H23N3O5S2/c1-14-15(2)22-29-21(14)19-5-6-20(30-19)31(25,26)24-9-7-23(8-10-24)12-16-3-4-17-18(11-16)28-13-27-17/h3-6,11H,7-10,12-13H2,1-2H3

InChI Key

AXVNIVHFAUXDTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27254575

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

461.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.511

Distribution Coefficient, logD

3.378

Water Solubility, LogSw

-3.68

Polar Surface Area

75.969

Acid Dissociation Constant (pKa)

24.60

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with L464-0551 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L464-0551?
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What is the minimum amount of L464-0551 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L464-0551
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L464-0551
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of L464-0551 available by request